ethyl N-[4-(1,3-benzothiazol-2-ylmethoxy)-2-methyl-phenyl]-N-propanoyl-carbamate

Systemtic Name: ethyl N-[4-(1,3-benzothiazol-2-ylmethoxy)-2-methyl-phenyl]-N-propanoyl-carbamate Openeye Name: ethyl N-[4-(1,3-benzothiazol-2-ylmethoxy)-2-methyl-phenyl]-N-propanoyl-carbamate CAS Name: N-[4-(1,3-benzothiazol-2-ylmethoxy)-2-methylphenyl]-N-(1-oxopropyl)carbamic acid ethyl ester IUPAC Name: ethyl N-[4-(1,3-benzothiazol-2-ylmethoxy)-2-methylphenyl]-N-propanoylcarbamate Traditional Name: N-[4-(1,3-benzothiazol-2-ylmethoxy)-2-methyl-phenyl]-N-propionyl-carbamic acid ethyl ester Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(C1=C(C=C(C=C1)OCC2=NC3=CC=CC=C3S2)C)C(=O)OCC

Isomeric SMILES

CCC(=O)N(C1=C(C=C(C=C1)OCC2=NC3=CC=CC=C3S2)C)C(=O)OCC

InChI

InChI=1S/C21H22N2O4S/c1-4-20(24)23(21(25)26-5-2)17-11-10-15(12-14(17)3)27-13-19-22-16-8-6-7-9-18(16)28-19/h6-12H,4-5,13H2,1-3H3